Molecule:100498: Difference between revisions
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molecule
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|moleculeKey=HPIOBCHPZVAATK-UHFFFAOYSA-N | |moleculeKey=HPIOBCHPZVAATK-UHFFFAOYSA-N | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-12132211302D | ||
0 0 0 0 0 0 0 0 0 0 0 V3000 | 0 0 0 0 0 0 0 0 0 0 0 V3000 | ||
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M V30 COUNTS 34 40 0 0 0 | M V30 COUNTS 34 40 0 0 0 | ||
M V30 BEGIN ATOM | M V30 BEGIN ATOM | ||
M V30 1 C | M V30 1 C 3.91233 -5.02307 0.0 0 | ||
M V30 2 C | M V30 2 C 5.61175 -5.0949 0.0 0 | ||
M V30 3 C | M V30 3 C 4.79605 -4.57907 0.0 0 | ||
M V30 4 C | M V30 4 C 5.54977 -6.15186 0.0 0 | ||
M V30 5 C | M V30 5 C 3.85256 -6.01368 0.0 0 | ||
M V30 6 C | M V30 6 C 4.67931 -6.56731 0.0 0 | ||
M V30 7 N | M V30 7 N 6.52883 -4.61422 0.0 0 | ||
M V30 8 C 7. | M V30 8 C 7.35622 -5.19678 0.0 0 | ||
M V30 9 | M V30 9 N 6.38401 -6.72673 0.0 0 | ||
M V30 10 | M V30 10 C 7.28677 -6.24949 0.0 0 | ||
M V30 11 C 8. | M V30 11 C 8.23608 -4.78358 0.0 0 | ||
M V30 12 C | M V30 12 C 9.05543 -5.32508 0.0 0 | ||
M V30 13 C | M V30 13 C 8.12301 -6.76849 0.0 0 | ||
M V30 14 C | M V30 14 C 9.0033 -6.3106 0.0 0 | ||
M V30 15 C 5. | M V30 15 C 5.92738 -1.93392 0.0 0 | ||
M V30 16 C | M V30 16 C 7.61282 -2.10418 0.0 0 | ||
M V30 17 C | M V30 17 C 6.81538 -1.53199 0.0 0 | ||
M V30 18 C | M V30 18 C 7.53648 -3.11073 0.0 0 | ||
M V30 19 C | M V30 19 C 5.80613 -2.9432 0.0 0 | ||
M V30 20 C | M V30 20 C 6.61436 -3.57057 0.0 0 | ||
M V30 21 C | M V30 21 C 6.91444 -0.543705 0.0 0 | ||
M V30 22 C | M V30 22 C 7.81662 -0.136082 0.0 0 | ||
M V30 23 C | M V30 23 C 8.5177 -1.68395 0.0 0 | ||
M V30 24 C | M V30 24 C 8.61162 -0.704955 0.0 0 | ||
M V30 25 C | M V30 25 C 5.44403 -8.2802 0.0 0 | ||
M V30 26 C | M V30 26 C 7.16488 -8.3212 0.0 0 | ||
M V30 27 C | M V30 27 C 6.33191 -7.77319 0.0 0 | ||
M V30 28 C | M V30 28 C 7.12347 -9.33368 0.0 0 | ||
M V30 29 C | M V30 29 C 5.42799 -9.29335 0.0 0 | ||
M V30 30 C | M V30 30 C 6.26482 -9.80583 0.0 0 | ||
M V30 31 C | M V30 31 C 7.9617 -9.8423 0.0 0 | ||
M V30 32 C | M V30 32 C 7.94554 -10.8177 0.0 0 | ||
M V30 33 C | M V30 33 C 6.24409 -10.7847 0.0 0 | ||
M V30 34 C | M V30 34 C 7.09136 -11.2935 0.0 0 | ||
M V30 END ATOM | M V30 END ATOM | ||
M V30 BEGIN BOND | M V30 BEGIN BOND | ||
M V30 1 1 | M V30 1 2 3 1 | ||
M V30 2 2 2 | M V30 2 2 4 2 | ||
M V30 3 1 | M V30 3 1 1 5 | ||
M V30 4 2 | M V30 4 1 2 3 | ||
M V30 5 | M V30 5 2 5 6 | ||
M V30 6 | M V30 6 1 6 4 | ||
M V30 7 1 | M V30 7 1 8 7 | ||
M V30 8 1 | M V30 8 1 4 9 | ||
M V30 9 2 | M V30 9 1 7 2 | ||
M V30 10 1 9 10 | M V30 10 1 9 10 | ||
M V30 11 | M V30 11 2 10 8 | ||
M V30 12 | M V30 12 2 12 11 | ||
M V30 13 | M V30 13 1 10 13 | ||
M V30 14 1 | M V30 14 1 11 8 | ||
M V30 15 2 13 14 | M V30 15 2 13 14 | ||
M V30 16 1 14 | M V30 16 1 14 12 | ||
M V30 17 | M V30 17 2 17 15 | ||
M V30 18 | M V30 18 2 18 16 | ||
M V30 19 1 15 | M V30 19 1 15 19 | ||
M V30 20 | M V30 20 1 16 17 | ||
M V30 21 | M V30 21 2 19 20 | ||
M V30 22 | M V30 22 1 20 18 | ||
M V30 23 | M V30 23 2 22 21 | ||
M V30 24 | M V30 24 1 16 23 | ||
M V30 25 1 | M V30 25 1 21 17 | ||
M V30 26 2 | M V30 26 2 23 24 | ||
M V30 27 1 | M V30 27 1 24 22 | ||
M V30 28 | M V30 28 2 27 25 | ||
M V30 29 | M V30 29 2 28 26 | ||
M V30 30 | M V30 30 1 25 29 | ||
M V30 31 | M V30 31 1 26 27 | ||
M V30 32 | M V30 32 2 29 30 | ||
M V30 33 | M V30 33 1 30 28 | ||
M V30 34 | M V30 34 2 32 31 | ||
M V30 35 | M V30 35 1 30 33 | ||
M V30 36 1 | M V30 36 1 31 28 | ||
M V30 37 2 | M V30 37 2 33 34 | ||
M V30 38 1 32 | M V30 38 1 34 32 | ||
M V30 39 | M V30 39 1 9 27 | ||
M V30 40 1 | M V30 40 1 7 20 | ||
M V30 END BOND | M V30 END BOND | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles= | |smiles=C1C=CC2N(C3C=C4C=CC=CC4=CC=3)C3C=CC=CC=3N(C3C=C4C=CC=CC4=CC=3)C=2C=1 | ||
|inchi=1S/C32H22N2/c1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-22H | |inchi=1S/C32H22N2/c1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-22H | ||
|inchikey=HPIOBCHPZVAATK-UHFFFAOYSA-N | |inchikey=HPIOBCHPZVAATK-UHFFFAOYSA-N |
Revision as of 10:27, 16 January 2023
Properties | |
---|---|
CID | 20767396 |
CAS | 1934269-97-2 |
IUPAC-Name | 5,10-dinaphthalen-2-ylphenazine |
Abbreviation | Phen1 |
Trivialname | 510-di(2-naphthyl)-510-dihydrophenazine |
Exact mass | 434.178298710 |
Molecular formula | C32H22N2 |
LogP | n/a |
Has vendors | true |
Molecular role | n/a |
Synonyms | 510-di(2-naphthyl)-510-dihydrophenazine,510-dinaphthalen-2-ylphenazine,phenn_2naph,schembl13886639,at25797,cs-0105666,j3.651.778f,510-di(naphthalen-2-yl)-510-dihydrophenazine,510-di(2-naphthyl)-510-dihydrophenazine >=97% |
5,10-Di(2-naphthyl)-5,10-dihydrophenazine
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